Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zzi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 SER 3.A OG no hydrogen 3.246 N/A SER 3.A OG THR 1.A OG1 no hydrogen 3.246 N/A ILE 6.A N ARG 2.A O no hydrogen 2.682 N/A GLN 7.A N SER 3.A O no hydrogen 3.466 N/A GLN 7.A NE2 GLN 269.A OE1 no hydrogen 3.668 N/A LEU 8.A N THR 4.A O no hydrogen 3.028 N/A LEU 9.A N VAL 5.A O no hydrogen 3.058 N/A ASN 10.A N ILE 6.A O no hydrogen 2.750 N/A ASN 11.A N LEU 8.A O no hydrogen 3.030 N/A ILE 12.A N LEU 9.A O no hydrogen 2.919 N/A SER 13.A N GLU 17.A OE1 no hydrogen 3.323 N/A SER 13.A OG GLU 17.A OE1 no hydrogen 3.341 N/A SER 13.A OG GLU 17.A OE2 no hydrogen 3.074 N/A VAL 18.A N THR 14.A O no hydrogen 3.455 N/A GLU 19.A N LYS 15.A O no hydrogen 3.182 N/A GLN 20.A N ARG 16.A O no hydrogen 3.054 N/A GLN 20.A NE2 LEU 366.A O no hydrogen 3.564 N/A TYR 21.A N GLU 17.A O no hydrogen 2.907 N/A LEU 22.A N VAL 18.A O no hydrogen 3.080 N/A LYS 23.A N GLU 19.A O no hydrogen 3.196 N/A TYR 24.A N GLN 20.A O no hydrogen 3.419 N/A TYR 24.A N TYR 21.A O no hydrogen 3.102 N/A PHE 25.A N TYR 21.A O no hydrogen 3.249 N/A THR 26.A N LEU 22.A O no hydrogen 2.633 N/A THR 26.A OG1 LEU 22.A O no hydrogen 2.781 N/A SER 27.A N LYS 23.A O no hydrogen 3.090 N/A SER 29.A OG SER 27.A O no hydrogen 3.088 N/A GLN 30.A N VAL 28.A O no hydrogen 2.869 N/A GLN 30.A NE2 VAL 28.A O no hydrogen 3.539 N/A VAL 35.A N LYS 199.A O no hydrogen 3.189 N/A ILE 36.A N ILE 65.A O no hydrogen 2.915 N/A LYS 37.A N VAL 201.A O no hydrogen 2.861 N/A VAL 38.A N LEU 67.A O no hydrogen 2.839 N/A ILE 42.A N GLY 39.A O no hydrogen 3.140 N/A SER 44.A N GLY 40.A O no hydrogen 3.233 N/A SER 44.A OG GLY 40.A O no hydrogen 3.357 N/A SER 44.A OG ALA 41.A O no hydrogen 3.501 N/A ASP 45.A N ALA 41.A O no hydrogen 3.246 N/A ASN 46.A N ILE 42.A O no hydrogen 2.761 N/A ALA 51.A N LEU 47.A O no hydrogen 2.847 N/A SER 52.A N HIS 48.A O no hydrogen 2.817 N/A CYS 53.A N GLU 49.A O no hydrogen 3.090 N/A LEU 54.A N LEU 50.A O no hydrogen 2.882 N/A ALA 55.A N ALA 51.A O no hydrogen 2.781 N/A PHE 56.A N SER 52.A O no hydrogen 3.264 N/A LEU 57.A N CYS 53.A O no hydrogen 3.286 N/A TYR 58.A N LEU 54.A O no hydrogen 2.962 N/A HIS 59.A N ALA 55.A O no hydrogen 2.775 N/A VAL 60.A N PHE 56.A O no hydrogen 2.810 N/A GLY 61.A N TYR 58.A O no hydrogen 3.186 N/A ILE 65.A N ALA 34.A O no hydrogen 2.942 N/A VAL 66.A N PRO 166.A O no hydrogen 3.103 N/A LEU 67.A N ILE 36.A O no hydrogen 2.972 N/A HIS 68.A N LEU 168.A O no hydrogen 2.990 N/A HIS 68.A ND1 GLY 69.A O no hydrogen 3.086 N/A GLY 69.A N VAL 38.A O no hydrogen 2.994 N/A GLN 73.A NE2 GLY 40.A O no hydrogen 3.422 N/A ASN 75.A ND2 GLY 71.A O no hydrogen 3.085 N/A ASN 75.A ND2 TYR 87.A OH no hydrogen 3.505 N/A GLY 76.A N PRO 72.A O no hydrogen 3.207 N/A ARG 77.A N GLN 73.A O no hydrogen 3.112 N/A ARG 77.A NH2 GLU 108.A OE1 no hydrogen 3.175 N/A LEU 78.A N VAL 74.A O no hydrogen 2.878 N/A GLU 79.A N ASN 75.A O no hydrogen 3.184 N/A ALA 80.A N GLY 76.A O no hydrogen 2.562 N/A GLN 81.A N ARG 77.A O no hydrogen 2.953 N/A GLY 82.A N GLU 79.A O no hydrogen 3.025 N/A ILE 83.A N LEU 78.A O no hydrogen 2.782 N/A TYR 87.A OH ASN 75.A OD1 no hydrogen 3.284 N/A ILE 88.A N ILE 91.A O no hydrogen 3.047 N/A ILE 91.A N ILE 88.A O no hydrogen 3.026 N/A ARG 92.A NH1 ASN 75.A OD1 no hydrogen 3.148 N/A ILE 93.A N ASP 86.A O no hydrogen 3.283 N/A THR 94.A N TYR 142.A O no hydrogen 3.081 N/A THR 94.A OG1 ARG 92.A O no hydrogen 2.918 N/A THR 98.A N ASP 95.A OD1 no hydrogen 3.367 N/A THR 98.A OG1 ASP 95.A OD1 no hydrogen 2.624 N/A MET 99.A N ASP 95.A O no hydrogen 2.858 N/A ALA 100.A N GLU 96.A O no hydrogen 3.035 N/A VAL 102.A N THR 98.A O no hydrogen 2.867 N/A ARG 103.A N MET 99.A O no hydrogen 2.747 N/A LYS 104.A N ALA 100.A O no hydrogen 3.029 N/A LYS 104.A NZ GLU 108.A OE1 no hydrogen 3.502 N/A CYS 105.A N VAL 101.A O no hydrogen 3.350 N/A PHE 106.A N VAL 102.A O no hydrogen 3.030 N/A LEU 107.A N ARG 103.A O no hydrogen 2.937 N/A GLU 108.A N LYS 104.A O no hydrogen 3.088 N/A GLN 109.A N CYS 105.A O no hydrogen 2.810 N/A GLN 109.A NE2 CYS 105.A O no hydrogen 3.422 N/A ASN 110.A N PHE 106.A O no hydrogen 2.836 N/A ASN 110.A ND2 HIS 68.A NE2 no hydrogen 3.048 N/A ASN 110.A ND2 ILE 167.A O no hydrogen 3.172 N/A LEU 111.A N LEU 107.A O no hydrogen 2.853 N/A LYS 112.A N GLU 108.A O no hydrogen 3.094 N/A LEU 113.A N GLN 109.A O no hydrogen 3.153 N/A LEU 113.A N ASN 110.A O no hydrogen 3.218 N/A VAL 114.A N ASN 110.A O no hydrogen 3.126 N/A THR 115.A N LEU 111.A O no hydrogen 2.719 N/A THR 115.A OG1 LEU 111.A O no hydrogen 3.163 N/A ALA 116.A N LYS 112.A O no hydrogen 3.196 N/A LEU 117.A N LEU 113.A O no hydrogen 2.955 N/A GLU 118.A N VAL 114.A O no hydrogen 2.871 N/A GLN 119.A N THR 115.A O no hydrogen 3.086 N/A LEU 120.A N ALA 116.A O no hydrogen 3.268 N/A LEU 120.A N LEU 117.A O no hydrogen 3.070 N/A GLY 121.A N GLU 118.A O no hydrogen 2.986 N/A VAL 122.A N LEU 117.A O no hydrogen 2.996 N/A ALA 124.A N GLU 118.A OE2 no hydrogen 2.887 N/A ARG 125.A N LEU 165.A O no hydrogen 3.107 N/A ILE 127.A N ILE 167.A O no hydrogen 2.966 N/A SER 129.A OG GLU 173.A OE1 no hydrogen 3.351 N/A GLY 130.A N GLU 173.A OE2 no hydrogen 2.956 N/A THR 133.A N SER 150.A O no hydrogen 2.936 N/A ALA 134.A N GLU 173.A O no hydrogen 2.879 N/A ASP 135.A N ASN 147.A O no hydrogen 3.138 N/A LEU 137.A N VAL 145.A O no hydrogen 2.660 N/A ASP 140.A N ASP 138.A OD1 no hydrogen 3.112 N/A LYS 141.A N ASP 138.A O no hydrogen 3.244 N/A LYS 141.A N ASP 138.A OD1 no hydrogen 3.390 N/A TYR 142.A N ASP 138.A O no hydrogen 2.908 N/A LEU 144.A N THR 94.A O no hydrogen 3.189 N/A VAL 145.A N LYS 143.A O no hydrogen 2.846 N/A GLY 146.A N ASN 181.A O no hydrogen 2.927 N/A ASN 147.A N ASP 135.A O no hydrogen 2.592 N/A LYS 149.A N THR 133.A O no hydrogen 3.012 N/A SER 150.A N THR 133.A O no hydrogen 3.448 N/A THR 152.A N VAL 131.A O no hydrogen 2.837 N/A THR 152.A OG1 GLY 130.A O no hydrogen 3.164 N/A THR 152.A OG1 VAL 131.A O no hydrogen 3.190 N/A GLU 157.A N LYS 153.A O no hydrogen 2.845 N/A ALA 158.A N GLU 154.A O no hydrogen 2.924 N/A SER 159.A N PRO 155.A O no hydrogen 3.058 N/A SER 159.A OG ALA 164.A O no hydrogen 2.412 N/A ILE 160.A N ILE 156.A O no hydrogen 3.354 N/A LYS 161.A N GLU 157.A O no hydrogen 2.888 N/A GLY 163.A N SER 159.A O no hydrogen 2.768 N/A GLY 163.A N ILE 160.A O no hydrogen 2.818 N/A ALA 164.A N SER 159.A O no hydrogen 3.369 N/A LEU 165.A N ARG 123.A O no hydrogen 2.688 N/A ILE 167.A N ARG 125.A O no hydrogen 3.156 N/A LEU 168.A N VAL 66.A O no hydrogen 2.806 N/A SER 170.A OG VAL 182.A O no hydrogen 3.273 N/A ALA 172.A N LEU 180.A O no hydrogen 3.381 N/A GLU 173.A N PHE 132.A O no hydrogen 2.936 N/A THR 174.A N GLN 178.A O no hydrogen 3.003 N/A THR 174.A OG1 GLN 178.A O no hydrogen 3.429 N/A GLY 177.A N THR 174.A O no hydrogen 3.084 N/A GLY 177.A N THR 174.A OG1 no hydrogen 3.166 N/A GLN 178.A NE2 MET 179.A O no hydrogen 2.580 N/A LEU 180.A N ALA 172.A O no hydrogen 2.931 N/A ASN 181.A N LEU 144.A O no hydrogen 3.178 N/A ASP 185.A N ASN 183.A OD1 no hydrogen 3.164 N/A ALA 187.A N ASN 183.A O no hydrogen 2.875 N/A ALA 188.A N ALA 184.A O no hydrogen 3.085 N/A GLY 189.A N ASP 185.A O no hydrogen 3.100 N/A GLU 190.A N VAL 186.A O no hydrogen 2.998 N/A LEU 191.A N ALA 187.A O no hydrogen 3.041 N/A ALA 192.A N ALA 188.A O no hydrogen 2.972 N/A ARG 193.A N GLY 189.A O no hydrogen 3.130 N/A VAL 194.A N GLU 190.A O no hydrogen 3.342 N/A VAL 194.A N LEU 191.A O no hydrogen 2.643 N/A PHE 195.A N LEU 191.A O no hydrogen 2.927 N/A GLU 196.A N ALA 192.A O no hydrogen 2.988 N/A LEU 198.A N GLN 32.A O no hydrogen 3.241 N/A LYS 199.A N PHE 33.A O no hydrogen 3.035 N/A LYS 199.A NZ TYR 24.A OH no hydrogen 2.481 N/A LYS 199.A NZ SER 259.A OG no hydrogen 2.854 N/A ILE 200.A N SER 259.A O no hydrogen 2.876 N/A VAL 201.A N VAL 35.A O no hydrogen 2.961 N/A TYR 202.A N ALA 261.A O no hydrogen 2.910 N/A LEU 203.A N LYS 37.A O no hydrogen 2.933 N/A GLY 207.A N ASN 204.A OD1 no hydrogen 2.692 N/A ASN 211.A N GLU 216.A O no hydrogen 2.802 N/A SER 213.A N ASN 211.A OD1 no hydrogen 3.065 N/A SER 213.A OG ASN 211.A OD1 no hydrogen 2.578 N/A GLY 215.A N ASN 211.A O no hydrogen 2.644 N/A GLU 216.A N THR 214.A OG1 no hydrogen 3.224 N/A LYS 217.A NZ GLY 207.A O no hydrogen 2.189 N/A ILE 218.A N ILE 209.A O no hydrogen 2.946 N/A ILE 221.A N MET 281.A O no hydrogen 3.088 N/A ASN 222.A N GLU 226.A OE1 no hydrogen 3.074 N/A LEU 223.A N ARG 283.A O no hydrogen 2.801 N/A ASP 224.A N ARG 284.A O no hydrogen 3.144 N/A GLU 226.A N ASN 222.A O no hydrogen 2.853 N/A TYR 227.A N LEU 223.A O no hydrogen 2.764 N/A LEU 230.A N GLU 226.A O no hydrogen 2.921 N/A LEU 230.A N TYR 227.A O no hydrogen 3.332 N/A MET 231.A N TYR 227.A O no hydrogen 2.803 N/A LYS 232.A N ASP 228.A O no hydrogen 3.216 N/A TRP 235.A NE1 GLN 233.A OE1 no hydrogen 3.032 N/A LYS 241.A N LYS 237.A O no hydrogen 2.989 N/A LEU 242.A N TYR 238.A O no hydrogen 2.875 N/A LYS 243.A N THR 240.A O no hydrogen 2.824 N/A LYS 243.A NZ ASP 185.A OD2 no hydrogen 3.222 N/A ILE 244.A N THR 240.A O no hydrogen 2.660 N/A ARG 245.A N LYS 241.A O no hydrogen 2.898 N/A ILE 247.A N LYS 243.A O no hydrogen 2.838 N/A LYS 248.A N ILE 244.A O no hydrogen 2.946 N/A LYS 248.A NZ ASP 252.A OD1 no hydrogen 3.566 N/A LYS 248.A NZ ASP 252.A OD2 no hydrogen 2.739 N/A GLU 249.A N ARG 245.A O no hydrogen 2.902 N/A LEU 250.A N GLU 246.A O no hydrogen 3.197 N/A LEU 251.A N ILE 247.A O no hydrogen 2.987 N/A ASP 252.A N LYS 248.A O no hydrogen 2.950 N/A TYR 253.A N LEU 250.A O no hydrogen 3.197 N/A ARG 256.A NH2 GLU 338.A OE1 no hydrogen 3.392 N/A SER 258.A N PRO 255.A O no hydrogen 3.402 N/A SER 258.A OG PRO 197.A O no hydrogen 2.536 N/A SER 259.A N LEU 198.A O no hydrogen 2.982 N/A VAL 260.A N ILE 282.A O no hydrogen 2.940 N/A ALA 261.A N ILE 200.A O no hydrogen 2.871 N/A ILE 262.A N THR 280.A O no hydrogen 2.848 N/A ILE 263.A N TYR 202.A O no hydrogen 3.273 N/A GLN 266.A N ASN 264.A OD1 no hydrogen 3.082 N/A ASP 267.A N ASN 264.A O no hydrogen 3.086 N/A LEU 268.A N VAL 265.A O no hydrogen 3.088 N/A LEU 272.A N LEU 268.A O no hydrogen 2.983 N/A PHE 273.A N LYS 270.A O no hydrogen 3.140 N/A THR 274.A N LYS 270.A O no hydrogen 3.058 N/A THR 274.A OG1 GLU 17.A OE2 no hydrogen 2.555 N/A SER 276.A N THR 274.A OG1 no hydrogen 3.094 N/A THR 280.A N ILE 262.A O no hydrogen 3.082 N/A THR 280.A OG1 ILE 218.A O no hydrogen 2.623 N/A MET 281.A N SER 219.A O no hydrogen 2.648 N/A ILE 282.A N VAL 260.A O no hydrogen 2.719 N/A ARG 283.A N ILE 221.A O no hydrogen 3.119 N/A ARG 284.A NE LEU 251.A O no hydrogen 2.996 N/A VAL 289.A N ALA 336.A O no hydrogen 2.730 N/A ARG 291.A N SER 334.A O no hydrogen 2.772 N/A GLU 296.A N SER 293.A O no hydrogen 2.773 N/A LYS 305.A N ASP 301.A O no hydrogen 3.151 N/A ALA 306.A N ALA 302.A O no hydrogen 2.889 N/A LEU 307.A N LEU 303.A O no hydrogen 2.913 N/A GLN 308.A N ARG 304.A O no hydrogen 3.052 N/A ARG 309.A N ALA 306.A O no hydrogen 3.094 N/A ARG 309.A NH1 LYS 305.A O no hydrogen 3.251 N/A ASP 310.A N LEU 307.A O no hydrogen 3.274 N/A GLY 312.A N ASP 310.A OD1 no hydrogen 2.727 N/A SER 314.A N ASP 310.A O no hydrogen 2.946 N/A SER 314.A OG ASP 310.A O no hydrogen 3.186 N/A SER 315.A OG ALA 311.A O no hydrogen 2.583 N/A LYS 317.A N GLY 312.A O no hydrogen 3.475 N/A SER 322.A OG SER 319.A O no hydrogen 2.805 N/A TYR 323.A N SER 319.A O no hydrogen 3.213 N/A TYR 323.A OH ASP 356.A OD2 no hydrogen 2.983 N/A LEU 324.A N VAL 320.A O no hydrogen 2.626 N/A ARG 325.A N ALA 321.A O no hydrogen 3.103 N/A LEU 327.A N TYR 323.A O no hydrogen 2.913 N/A GLU 328.A N LEU 324.A O no hydrogen 2.977 N/A ASN 329.A N ARG 325.A O no hydrogen 3.309 N/A VAL 333.A N VAL 346.A O no hydrogen 3.059 N/A SER 334.A N ARG 291.A O no hydrogen 2.791 N/A TYR 335.A OH ASP 380.A OD2 no hydrogen 2.709 N/A ALA 336.A N VAL 289.A O no hydrogen 3.354 N/A LEU 340.A N ASP 337.A O no hydrogen 3.276 N/A ALA 342.A N ASP 337.A OD1 no hydrogen 2.988 N/A VAL 343.A N VAL 359.A O no hydrogen 3.050 N/A ALA 344.A N TYR 335.A O no hydrogen 2.875 N/A ILE 345.A N LYS 357.A O no hydrogen 2.748 N/A VAL 346.A N VAL 333.A O no hydrogen 2.778 N/A LYS 348.A N ASP 331.A O no hydrogen 3.284 N/A THR 354.A N LYS 347.A O no hydrogen 3.099 N/A LEU 355.A N GLN 385.A O no hydrogen 2.992 N/A ASP 356.A N ILE 345.A O no hydrogen 2.762 N/A LYS 357.A N ILE 345.A O no hydrogen 3.411 N/A VAL 359.A N VAL 343.A O no hydrogen 2.727 N/A SER 361.A N GLU 341.A O no hydrogen 2.970 N/A SER 361.A OG GLU 341.A OE2 no hydrogen 3.218 N/A ALA 363.A N SER 361.A OG no hydrogen 3.056 N/A TRP 365.A N SER 361.A O no hydrogen 2.948 N/A LEU 366.A N ASP 362.A O no hydrogen 3.378 N/A ASN 367.A N ALA 363.A O no hydrogen 3.108 N/A ASN 368.A N TRP 365.A O no hydrogen 3.156 N/A VAL 369.A N ALA 364.A O no hydrogen 3.106 N/A THR 370.A N ALA 364.A O no hydrogen 3.511 N/A THR 370.A OG1 ASP 371.A OD1 no hydrogen 3.418 N/A VAL 373.A N VAL 369.A O no hydrogen 2.883 N/A PHE 374.A N THR 370.A O no hydrogen 3.092 N/A ASN 375.A N ASP 371.A O no hydrogen 3.186 N/A VAL 376.A N ASN 372.A O no hydrogen 3.055 N/A LEU 377.A N VAL 373.A O no hydrogen 3.146 N/A ARG 378.A N PHE 374.A O no hydrogen 2.884 N/A ARG 378.A NH2 LYS 401.A O no hydrogen 3.123 N/A ASP 380.A N VAL 376.A O no hydrogen 3.087 N/A PHE 381.A N LEU 377.A O no hydrogen 2.721 N/A LEU 384.A N TYR 416.A O no hydrogen 3.070 N/A GLN 385.A N PRO 353.A O no hydrogen 3.091 N/A GLN 385.A NE2 VAL 352.A O no hydrogen 2.948 N/A TRP 386.A N PHE 414.A O no hydrogen 2.747 N/A TRP 386.A NE1 HIS 398.A ND1 no hydrogen 2.992 N/A VAL 388.A N VAL 412.A O no hydrogen 2.864 N/A GLU 390.A N GLY 410.A O no hydrogen 2.780 N/A ASP 392.A N SER 389.A O no hydrogen 3.041 N/A ASN 394.A N ASP 392.A OD1 no hydrogen 2.942 N/A PHE 399.A N ILE 395.A O no hydrogen 2.980 N/A ASP 400.A N ALA 396.A O no hydrogen 3.095 N/A LYS 401.A N TRP 397.A O no hydrogen 3.107 N/A SER 402.A N PHE 399.A O no hydrogen 2.837 N/A SER 402.A OG PHE 399.A O no hydrogen 2.926 N/A GLN 403.A N TRP 415.A O no hydrogen 2.826 N/A GLY 404.A N TRP 415.A O no hydrogen 3.142 N/A TYR 406.A N LEU 413.A O no hydrogen 2.904 N/A LYS 408.A NZ SER 434.A OG no hydrogen 2.761 N/A LYS 411.A N GLY 409.A O no hydrogen 2.822 N/A VAL 412.A N VAL 388.A O no hydrogen 2.761 N/A LEU 413.A N TYR 406.A O no hydrogen 2.726 N/A PHE 414.A N TRP 386.A O no hydrogen 2.742 N/A TRP 415.A N GLY 404.A O no hydrogen 3.050 N/A TYR 416.A N LEU 384.A O no hydrogen 2.889 N/A TYR 416.A OH PHE 381.A O no hydrogen 2.987 N/A ASN 422.A ND2 ASP 420.A OD2 no hydrogen 3.205 N/A THR 423.A OG1 ASP 420.A O no hydrogen 3.246 N/A ILE 424.A N ASP 420.A O no hydrogen 2.865 N/A SER 425.A N ILE 421.A O no hydrogen 3.041 N/A SER 425.A OG ILE 421.A O no hydrogen 2.937 N/A SER 425.A OG ASN 422.A O no hydrogen 2.976 N/A GLU 426.A N ASN 422.A O no hydrogen 3.234 N/A LEU 427.A N THR 423.A O no hydrogen 3.219 N/A VAL 428.A N ILE 424.A O no hydrogen 3.010 N/A GLU 429.A N SER 425.A O no hydrogen 3.009 N/A ASN 430.A N GLU 426.A O no hydrogen 3.138 N/A ASN 430.A ND2 GLU 426.A O no hydrogen 2.721 N/A PHE 431.A N LEU 427.A O no hydrogen 2.962 N/A VAL 432.A N VAL 428.A O no hydrogen 2.885 N/A LYS 433.A N GLU 429.A O no hydrogen 2.672 N/A SER 434.A N PHE 431.A O no hydrogen 2.889 N/A SER 434.A OG PHE 431.A O no hydrogen 2.698 N/A CYS 435.A N VAL 432.A O no hydrogen 3.492 N/A